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CAS 40321-44-6 1-Pyrrolidinecarboxaldehyde, 2-oxo- molecular structure lightbox
CAS RN: 40321-44-6

1-Pyrrolidinecarboxaldehyde, 2-oxo-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250301 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-148462
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 40321-44-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 1 In Stock Hong Kong Inquiry
0.25g -- 1 In Stock Hong Kong Inquiry
0.25g ≥95% 1 In Stock Hong Kong Inquiry
1g ≥95% 1 In Stock Hong Kong Inquiry
0.1g -- 0 Out of Stock Shanghai Inquiry
1g -- 0 Out of Stock Hong Kong Inquiry
5g -- 0 Out of Stock Hong Kong Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

40321-44-6 / 2-oxopyrrolidine-1-carbaldehyde

Standard CAS: 40321-44-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
40321-44-6
Multi CAS
No
Molecular Formula
C5H7NO2
Molecular Weight
113.110000
Exact Mass
113.047678
InChI
InChI=1S/C5H7NO2/c7-4-6-3-1-2-5(6)8/h4H,1-3H2
InChIKey
XALHICXNSREUAV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.6
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
27.01
TPSA
37.38

LogP / Solubility

WLOGP
-0.23
MLOGP
-0.22
XLogP3
-0.4
Consensus LogP
-0.28
Log S (ESOL)
-0.33
Class (ESOL)
Very soluble
Log S (Ali)
-0.32
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.32
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.58

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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